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Thermodynamics 2024

Activity: Academic conferences and events (excluding conference publications)Conference presentation / attendance

Description

Delivered a short oral presentation on atomistic molecular dynamics simulations of the bio-derived solvent Cyrene. The work presented predictions of density, diffusion coefficient, viscosity, and vapour–liquid equilibrium behaviour, which form the basis for developing coarse-grained models capable of simulating larger time and length scales.
Period4 Sept 20246 Sept 2024
Event typeConference
LocationDelft, NetherlandsShow on map
Degree of RecognitionInternational

Keywords

  • Thermodynamics
  • Molecular dyamics
  • Transport properties
  • VLE
  • Coarse-grained modelling